cyclopropyl-(2-methoxyphenyl)methanimine

C11H13NO — CID 131860989

IUPACcyclopropyl-(2-methoxyphenyl)methanimine
SMILES[H]/N=C(/c1ccccc1OC)C1CC1
InChIInChI=1S/C11H13NO/c1-13-10-5-3-2-4-9(10)11(12)8-6-7-8/h2-5,8,12H,6-7H2,1H3/b12-11+
InChIKeyNNIZCGMNQJLACE-VAWYXSNFSA-N
MW175.23 g/mol
LogP2.47
Rot. Bonds3

About cyclopropyl-(2-methoxyphenyl)methanimine

cyclopropyl-(2-methoxyphenyl)methanimine (PubChem CID 131860989) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is cyclopropyl-(2-methoxyphenyl)methanimine.

Molecular Properties

Compound Namecyclopropyl-(2-methoxyphenyl)methanimine
PubChem CID131860989
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Namecyclopropyl-(2-methoxyphenyl)methanimine
SMILES[H]/N=C(/c1ccccc1OC)C1CC1
InChIInChI=1S/C11H13NO/c1-13-10-5-3-2-4-9(10)11(12)8-6-7-8/h2-5,8,12H,6-7H2,1H3/b12-11+
InChIKeyNNIZCGMNQJLACE-VAWYXSNFSA-N
XLogP2.47
TPSA33.08 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(2-methoxyphenyl)methanimine?
The IUPAC name of cyclopropyl-(2-methoxyphenyl)methanimine (CID 131860989) is cyclopropyl-(2-methoxyphenyl)methanimine.
What is the SMILES notation for cyclopropyl-(2-methoxyphenyl)methanimine?
The canonical SMILES for cyclopropyl-(2-methoxyphenyl)methanimine is [H]/N=C(/c1ccccc1OC)C1CC1.
What is the InChIKey of cyclopropyl-(2-methoxyphenyl)methanimine?
The InChIKey is NNIZCGMNQJLACE-VAWYXSNFSA-N. The full InChI is InChI=1S/C11H13NO/c1-13-10-5-3-2-4-9(10)11(12)8-6-7-8/h2-5,8,12H,6-7H2,1H3/b12-11+.
What are the key properties of cyclopropyl-(2-methoxyphenyl)methanimine?
cyclopropyl-(2-methoxyphenyl)methanimine has a molecular weight of 175.23 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(2-methoxyphenyl)methanimine is sourced from PubChem (CID 131860989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).